Hydrochloric Acid

Hydrochloric Acid

SCHEMBL811296

Cc1cc(C)c(N=CCc2cccc(CC=Nc3c(C)cc(C)cc3C)n2)c(C)c1.[Cl-].[Cl-].[Fe+2]

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
MAPK1 P28482 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL812525 0.97 NOS1 (0.39) NOS1NOS2MAPTHTTNPSR1
Hydrochloric Acid SCHEMBL3671010 0.90 NOS1 (0.33) NOS1NOS2
Hydrochloric Acid SCHEMBL16654018 0.89 POLB (0.31) NOS1NOS2NPSR1MEN1KMT2A
SCHEMBL23535362 0.88 NOS1 (0.34) NOS1NOS2
SCHEMBL16653951 0.87 NOS1 (0.35) NOS1NOS2
SCHEMBL4967907 0.86 NOS1 (0.33) NOS1NOS2MEN1KMT2A
SCHEMBL14830125 0.85 NOS1 (0.34) NOS1NOS2
SCHEMBL7053846 0.85 POLB (0.33) NOS1NOS2NPSR1MEN1KMT2A
SCHEMBL4970674 0.85 RAPGEF4 (0.34) NOS1NOS2MAPTHTTNPSR1
SCHEMBL20703459 0.83 NOS1 (0.35) NOS1NOS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2361281-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF Basell Polyolefine GmbH (DE) 2011-08-31 EP disclosed
EP-2344551-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF Basell Polyolefine GmbH (DE) 2011-07-20 EP disclosed
EP-2337811-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF Basell Polyolefine GmbH (DE) 2011-06-29 EP disclosed
EP-2326678-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF Basell Polyolefine GmbH (DE) 2011-06-01 EP disclosed
WO-2010034461-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF BASELL POLYOLEFINE GMBH (DE) 2010-04-01 WO disclosed
WO-2010034508-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF BASELL POLYOLEFINE GMBH (DE) 2010-04-01 WO disclosed
WO-2010034464-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF BASELL POLYOLEFINE GMBH (DE) 2010-04-01 WO disclosed
WO-2010034520-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF BASELL POLYOLEFINE GMBH (DE) 2010-04-01 WO disclosed
WO-2010034463-A1 IMPACT RESISTANT LLDPE COMPOSITION AND FILMS MADE THEREOF BASELL POLYOLEFINE GMBH (DE) 2010-04-01 WO disclosed
EP-1123321-A1 SUPPORTED BIDENTATE AND TRIDENTATE CATALYST COMPOSITIONS AND OLEFIN POLYMERIZATION USING SAME W.R. Grace & Co.-Conn. (US) 2001-08-16 EP disclosed
WO-2000020467-A1 SUPPORTED BIDENTATE AND TRIDENTATE CATALYST COMPOSITIONS AND OLEFIN POLYMERIZATION USING SAME W.R. GRACE & CO.-CONN (US) 2000-04-13 WO disclosed